Catalytic effect of (H(2)O)(n) (n = 1–3) on the HO(2) + NH(2) → NH(3) + (3)O(2) reaction under tropospheric conditions

The effects of (H(2)O)(n) (n = 1–3) clusters on the HO(2) + NH(2) → NH(3) + (3)O(2) reaction have been investigated by employing high-level quantum chemical calculations with M06-2X and CCSD(T) theoretical methods, and canonical variational transition (CVT) state theory with small curvature tunnelin...

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Detalles Bibliográficos
Autores principales: Zhang, Tianlei, Wang, Kai, Qiao, Zhangyu, Zhang, Yongqi, Geng, Lin, Wang, Rui, Wang, Zhiyin, Zhao, Caibin, Jin, Linxia
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2018
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9089316/
https://www.ncbi.nlm.nih.gov/pubmed/35557830
http://dx.doi.org/10.1039/c8ra06549g

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9089316/
https://www.ncbi.nlm.nih.gov/pubmed/35557830
http://dx.doi.org/10.1039/c8ra06549g

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